[(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]ammonium IUPAC Name: [(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(4-propylphenyl)-2-(1,2,4-triazol-1-yl)ethyl]ammonium Formula: C13H19N4+ MolecularWeight: 231.31676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CN2C=NC=N2)[NH3+]

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@@H](CN2C=NC=N2)[NH3+]

InChI

InChI=1S/C13H18N4/c1-2-3-11-4-6-12(7-5-11)13(14)8-17-10-15-9-16-17/h4-7,9-10,13H,2-3,8,14H2,1H3/p+1/t13-/m1/s1